AG003GYY

6294-93-5 | 4-Chloro-3-(trifluoromethyl)phenol

AG003GYY

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CAS Number	6294-93-5
Catalog Number	AG003GYY(AGN-PC-0JLSP8)
Chemical Name	4-Chloro-3-(trifluoromethyl)phenol
EC Number	613-117-2
IUPAC Name	4-chloro-3-(trifluoromethyl)phenol
InChI	InChI=1S/C7H4ClF3O/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3,12H
InChI Key	ZLFPIEUWXNRPNM-UHFFFAOYSA-N
MDL Number	MFCD00042525
Molecular Formula	C7H4ClF3O
Molecular Weight	196.5543
NSC Number	11757
SMILES	OC1=CC=C(Cl)C(C(F)(F)F)=C1
Synonyms	4-Chloro-3-(trifluoromethyl)phenol, 6294-93-5, 2-Chloro-5-hydroxybenzotrifluoride, 4-Chloro-3-trifluoromethylphenol, Phenol, 4-chloro-3-(trifluoromethyl)-, Phenol, p-chloro-m-trifluoromethyl-, Phenol, p-chloro-m-(trifluoromethyl)-, p-Chloro-m-trifluoromethylphenol, 4-Chloro-3-trifluoromethyl-phenol, NSC 11757, BRN 2261083, MFCD00042525, 2-CHLORO-5-HYDROXYBEZOTRIFLUORIDE, NSC11757, PubChem2863, AC1L2ZLF, WLN: QR DG CXFFF, AC1Q78UF, 4-06-00-02069 (Beilstein Handbook Reference), SCHEMBL364052, CTK4H8972, ZLFPIEUWXNRPNM-UHFFFAOYSA-, DTXSID00212146, ZLFPIEUWXNRPNM-UHFFFAOYSA-N, p-Chloro-m-(trifluoromethyl)phenol, JRD-0276, ZINC1718562, ANW-47101, CL8503, FC1195, NSC-11757, SBB092044, AKOS005254979, phenol, 4-chloro-3-(trifluoromethyl), AC-4128, AM61623, AS01745, CM11704, CS-W015692, MCULE-5583919244, PS-8264, RP25461, RTR-021665, TRA0062893, VZ24296, KS-000009B8, AJ-30909, AK-53838, AN-12251, CJ-06834, CJ-29133, SC-76168, AB0021135, DB-011329, LS-104275, ST2405716, A8690, FT-0081645, FT-0618054, ST50825407, TL80074141, V2367, C-4984, Phenol, 4-chloro-3-(trifluoromethyl)- (9CI), 4-Chloro-3-(trifluoromethyl)phenol, AldrichCPR, m-Cresol, 4-chloro-alpha,alpha,alpha-trifluoro-, 294C935, I01-3734, J-514989, m-Cresol, 4-chloro-alpha,alpha,alpha-trifluoro- (8CI), InChI=1/C7H4ClF3O/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3,12H, C7H4ClF3O, C7-H4-Cl-F3-O, CID80520, m-Cresol,.alpha.,.alpha.-trifluoro-, ACN-055922, C1516, 4-Chloro-3-(trifluoromethyl)phenol, 98% - 1G 1g, m-Cresol, 4-chloro-.alpha.,.alpha.,.alpha.-trifluoro-, 106032-62-6, 37900-81-5,

Complexity	159
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.99g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	196.553g/mol
Monoisotopic Mass	195.99g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H319
Packing Group	Ⅲ
Precautionary statements	P305+P351+P338
UN Code	UN 3261

Certificate of Analysis

Lot Number